2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitro-phenoxy]hexanoyl]amino]ethyl ethanoate

Systemtic Name: 2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitro-phenoxy]hexanoyl]amino]ethyl ethanoate Openeye Name: 2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitro-phenoxy]hexanoyl]amino]ethyl acetate CAS Name: acetic acid 2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitrophenoxy]-1-oxohexyl]amino]ethyl ester IUPAC Name: 2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitrophenoxy]hexanoyl]amino]ethyl acetate Traditional Name: acetic acid 2-[cyclohexyl-[6-[3-(1-hydroxyethyl)-2-nitro-phenoxy]hexanoyl]amino]ethyl ester Formula: C24H36N2O7 MolecularWeight: 464.55184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CC=C1)OCCCCCC(=O)N(CCOC(=O)C)C2CCCCC2)[N+](=O)[O-])O

Isomeric SMILES

CC(C1=C(C(=CC=C1)OCCCCCC(=O)N(CCOC(=O)C)C2CCCCC2)[N+](=O)[O-])O

InChI

InChI=1S/C24H36N2O7/c1-18(27)21-12-9-13-22(24(21)26(30)31)33-16-8-4-7-14-23(29)25(15-17-32-19(2)28)20-10-5-3-6-11-20/h9,12-13,18,20,27H,3-8,10-11,14-17H2,1-2H3